首页> 外文OA文献 >(1S,2R,4S)-1-[(Benzyl­amino)­meth­yl]-4-(prop-1-en-2-yl)cyclo­hexane-1,2-diol
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(1S,2R,4S)-1-[(Benzyl­amino)­meth­yl]-4-(prop-1-en-2-yl)cyclo­hexane-1,2-diol

机译:(1S,2R,4S)-1-[[(苄氨基)甲基] -4-(丙-1-烯-2-基)环己烷-1,2-二醇

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摘要

The title compound, C17H25NO2, was synthesized by epoxidation of the double bond of (S)-perillyl alcohol [(S)-4-isopropenyl-1-cyclo­hexenyl­methanol], followed by the oxirane ring-opening by benzyl­amine using [Ca(CF3CO2)2] as catalyst under solvent-free condition at 313 K. The mol­ecular conformation is stabilized by an intra­molecular O—H⋯N hydrogen bond. In the crystal, mol­ecules are linked by inter­molecular N—H⋯O hydrogen bonds, forming chains parallel to the a axis, which are further connected by O—H⋯O hydrogen bonds into sheets parallel to (010). The absolute configuration of the mol­ecule is known from the synthetic procedure.
机译:通过环氧化(S)-紫苏醇[(S)-4-异丙烯基-1-环己烯基甲醇]的双键,然后使用[Ca(CF3CO2),通过苄胺使环氧乙烷开环,来合成标题化合物C17H25NO2 2]作为无溶剂条件下的催化剂,在313 catalystK下通过分子内O-H⋯N氢键稳定分子构象。在晶体中,分子通过分子间的N-H = O氢键连接,形成平行于a轴的链,并通过O-H = O氢键进一步连接成平行于(010)的薄片。分子的绝对构型由合成方法得知。

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